5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol

C13H19NO3 — CID 10466682

IUPAC5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol
SMILESCCCN1CCO[C@H](c2cc(O)cc(O)c2)C1
InChIInChI=1S/C13H19NO3/c1-2-3-14-4-5-17-13(9-14)10-6-11(15)8-12(16)7-10/h6-8,13,15-16H,2-5,9H2,1H3/t13-/m0/s1
InChIKeyVZDVSSOINOOOOJ-ZDUSSCGKSA-N
MW237.30 g/mol
LogP1.88
Rot. Bonds3

About 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol

5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol (PubChem CID 10466682) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol.

Molecular Properties

Compound Name5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol
PubChem CID10466682
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol
SMILESCCCN1CCO[C@H](c2cc(O)cc(O)c2)C1
InChIInChI=1S/C13H19NO3/c1-2-3-14-4-5-17-13(9-14)10-6-11(15)8-12(16)7-10/h6-8,13,15-16H,2-5,9H2,1H3/t13-/m0/s1
InChIKeyVZDVSSOINOOOOJ-ZDUSSCGKSA-N
XLogP1.88
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol?
The IUPAC name of 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol (CID 10466682) is 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol.
What is the SMILES notation for 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol?
The canonical SMILES for 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol is CCCN1CCO[C@H](c2cc(O)cc(O)c2)C1.
What is the InChIKey of 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol?
The InChIKey is VZDVSSOINOOOOJ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H19NO3/c1-2-3-14-4-5-17-13(9-14)10-6-11(15)8-12(16)7-10/h6-8,13,15-16H,2-5,9H2,1H3/t13-/m0/s1.
What are the key properties of 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol?
5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol has a molecular weight of 237.30 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-4-propylmorpholin-2-yl]benzene-1,3-diol is sourced from PubChem (CID 10466682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).